Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | GLA | P06280 | 1/20 | 0.54 |
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.54 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.51 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.50 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.50 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.50 |
| ▸ | ACMSD | Q8TDX5 | 2/20 | 0.49 |
| ▸ | ME2 | P23368 | 1/20 | 0.47 |
| ▸ | ME1 | P48163 | 1/20 | 0.47 |
| ▸ | ME3 | Q16798 | 1/20 | 0.47 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.46 |
| ▸ | DHODH | Q02127 | 5/20 | 0.46 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.44 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL8440978 | 0.88 | MEN1 (0.58) | CYP1A2KDM4EMEN1ALDH1A1GLA | |
| SCHEMBL338938 | 0.87 | MEN1 (0.61) | CYP1A2KDM4EMEN1ALDH1A1GLA | |
| SCHEMBL10783912 | 0.83 | CYP1A2 (0.55) | CYP1A2KDM4EMEN1ALDH1A1GLA | |
| SCHEMBL25439101 | 0.80 | HDAC4 (0.54) | CYP1A2KDM4EMEN1ALDH1A1HPGD | |
| SCHEMBL18575575 | 0.79 | GPR84 (0.57) | CYP1A2KDM4EMEN1ALDH1A1HPGD | |
| SCHEMBL30421930 | 0.76 | MEN1 (0.54) | CYP1A2KDM4EMEN1ALDH1A1GLA | |
| SCHEMBL1661025 | 0.76 | MEN1 (0.54) | CYP1A2KDM4EMEN1ALDH1A1GLA | |
| SCHEMBL29779946 | 0.75 | CYP1A2 (0.68) | CYP1A2KDM4EMEN1ALDH1A1GLA | |
| SCHEMBL88986 | 0.75 | CYP1A2 (0.68) | CYP1A2KDM4EMEN1ALDH1A1GLA | |
| SCHEMBL5553181 | 0.75 | MEN1 (0.49) | CYP1A2KDM4EMEN1ALDH1A1GLA |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1997048672-A2 | SUBSTITUTED TETRAHYDRONAPHTHALENE AND DIHYDRONAPHTHALENE DERIVATIVES HAVING RETINOID AND/OR RETINOID ANTAGONIST-LIKE BIOLOGICAL ACTIVITY | ALLERGAN SALES, INC. (US) | 1997-12-24 | — | — | WO | disclosed |